5-bromanyl-6-methoxy-2-[[4-[3-(4H-pyrazol-3-yl)propoxy]phenoxy]methyl]quinoline

Systemtic Name: 5-bromanyl-6-methoxy-2-[[4-[3-(4H-pyrazol-3-yl)propoxy]phenoxy]methyl]quinoline Openeye Name: 5-bromo-6-methoxy-2-[[4-[3-(4H-pyrazol-3-yl)propoxy]phenoxy]methyl]quinoline CAS Name: 5-bromo-6-methoxy-2-[[4-[3-(4H-pyrazol-3-yl)propoxy]phenoxy]methyl]quinoline IUPAC Name: 5-bromo-6-methoxy-2-[[4-[3-(4H-pyrazol-3-yl)propoxy]phenoxy]methyl]quinoline Traditional Name: 5-bromo-6-methoxy-2-[[4-[3-(4H-pyrazol-3-yl)propoxy]phenoxy]methyl]quinoline Formula: C23H22BrN3O3 MolecularWeight: 468.34308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)N=C(C=C2)COC3=CC=C(C=C3)OCCCC4=NN=CC4)Br

Isomeric SMILES

COC1=C(C2=C(C=C1)N=C(C=C2)COC3=CC=C(C=C3)OCCCC4=NN=CC4)Br

InChI

InChI=1S/C23H22BrN3O3/c1-28-22-11-10-21-20(23(22)24)9-4-17(26-21)15-30-19-7-5-18(6-8-19)29-14-2-3-16-12-13-25-27-16/h4-11,13H,2-3,12,14-15H2,1H3